[2-oxidanylidene-2-[2-(phenylcarbonyl)hydrazinyl]ethyl] 3-bromanyl-5-(4-methylpiperidin-1-yl)sulfonyl-benzoate

Systemtic Name: [2-oxidanylidene-2-[2-(phenylcarbonyl)hydrazinyl]ethyl] 3-bromanyl-5-(4-methylpiperidin-1-yl)sulfonyl-benzoate Openeye Name: [2-(2-benzoylhydrazino)-2-oxo-ethyl] 3-bromo-5-[(4-methyl-1-piperidyl)sulfonyl]benzoate CAS Name: 3-bromo-5-[(4-methyl-1-piperidinyl)sulfonyl]benzoic acid [2-(benzoylhydrazo)-2-oxoethyl] ester IUPAC Name: [2-(2-benzoylhydrazinyl)-2-oxoethyl] 3-bromo-5-(4-methylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 3-bromo-5-(4-methylpiperidino)sulfonyl-benzoic acid [2-(N'-benzoylhydrazino)-2-keto-ethyl] ester Formula: C22H24BrN3O6S MolecularWeight: 538.41146

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC(=CC(=C2)C(=O)OCC(=O)NNC(=O)C3=CC=CC=C3)Br

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC(=CC(=C2)C(=O)OCC(=O)NNC(=O)C3=CC=CC=C3)Br

InChI

InChI=1S/C22H24BrN3O6S/c1-15-7-9-26(10-8-15)33(30,31)19-12-17(11-18(23)13-19)22(29)32-14-20(27)24-25-21(28)16-5-3-2-4-6-16/h2-6,11-13,15H,7-10,14H2,1H3,(H,24,27)(H,25,28)